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    Chemistry

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    Also known as: 77337-73-6, Campral, Campral ec, Alcomed, Sobriol, Aotal
    Molecular Formula
    C10H20CaN2O8S2
    Molecular Weight
    400.5  g/mol
    InChI Key
    BUVGWDNTAWHSKI-UHFFFAOYSA-L
    FDA UNII
    59375N1D0U
    Acamprosate Calcium
    Structural analog of taurine that is used for the prevention of relapse in individuals with ALCOHOLISM.
    1 2D Structure

    Acamprosate Calcium

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    calcium;3-acetamidopropane-1-sulfonate
    2.1.2 InChI
    InChI=1S/2C5H11NO4S.Ca/c2*1-5(7)6-3-2-4-11(8,9)10;/h2*2-4H2,1H3,(H,6,7)(H,8,9,10);/q;;+2/p-2
    2.1.3 InChI Key
    BUVGWDNTAWHSKI-UHFFFAOYSA-L
    2.1.4 Canonical SMILES
    CC(=O)NCCCS(=O)(=O)[O-].CC(=O)NCCCS(=O)(=O)[O-].[Ca+2]
    2.2 Other Identifiers
    2.2.1 UNII
    59375N1D0U
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Acamprosate

    2. Acamprostate

    3. Acetyl Homotaurinate, Calcium

    4. Acetylhomotaurinate, Calcium

    5. Acetylhomotaurine, Calcium

    6. Acetylhomotaurine, Sodium

    7. Aotal

    8. Calcium Acetyl Homotaurinate

    9. Calcium Acetylhomotaurinate

    10. Calcium Acetylhomotaurine

    11. Campral

    12. Campral Ec

    13. N Acetylhomotaurine

    14. N Acetylhomotaurine, Monolithium Salt

    15. N Acetylhomotaurine, Monopotassium Salt

    16. N Acetylhomotaurine, Monosodium Salt

    17. N-acetylhomotaurine

    18. N-acetylhomotaurine, Calcium (2:1) Salt

    19. N-acetylhomotaurine, Magnesium (2:1) Salt

    20. N-acetylhomotaurine, Monolithium Salt

    21. N-acetylhomotaurine, Monopotassium Salt

    22. N-acetylhomotaurine, Monosodium Salt

    23. N-acetylhomotaurine, Zinc (2:1) Salt

    24. Regtect

    25. Sodium Acetylhomotaurine

    26. Zulex

    2.3.2 Depositor-Supplied Synonyms

    1. 77337-73-6

    2. Campral

    3. Campral Ec

    4. Alcomed

    5. Sobriol

    6. Aotal

    7. Calcium 3-acetamidopropane-1-sulfonate

    8. Calcium Acetylhomotaurinate

    9. Acamprosate Calcium [usan]

    10. Calcium N-acetylhomotaurinate

    11. Calcium 3-(acetylamino)propane-1-sulfonate

    12. 1-propanesulfonic Acid, 3-(acetylamino)-, Calcium Salt (2:1)

    13. Acamprosate (calcium)

    14. Nsc-759186

    15. Chebi:51042

    16. Sn-102

    17. 59375n1d0u

    18. Calcium Bis(3-acetamidopropane-1-sulfonate)

    19. Dsstox_cid_27529

    20. Dsstox_rid_82399

    21. Dsstox_gsid_47529

    22. 77337-73-6 (calcium Salt); 77337-76-9 (free Acid).

    23. Calcium Acamprosate

    24. Cas-77337-73-6

    25. Calcium(2+) 3-(acetylamino)propanesulphonate

    26. Ncgc00167462-01

    27. Einecs 278-665-3

    28. N-acetylhomotaurine Calcium

    29. Unii-59375n1d0u

    30. Campral (tn)

    31. Regtect (tn)

    32. Calcium;3-acetamidopropane-1-sulfonate

    33. Calcium 3-(acetylamino)propanesulphonate

    34. Acamprosate Calcium- Bio-x

    35. Schembl137771

    36. 3-(acetylamino)-1-propanesulfonic Acid Calcium Salt

    37. Acamprosate Calcium [mi]

    38. Chembl2068724

    39. Dtxsid6047529

    40. Acamprosate Calcium (jan/usan)

    41. Acamprosate Calcium [jan]

    42. Hms3264j11

    43. Hms3713l22

    44. Pharmakon1600-01505711

    45. Acamprosate Calcium [mart.]

    46. Tox21_112466

    47. Tox21_302606

    48. Acamprosate Calcium [usp-rs]

    49. Acamprosate Calcium [who-dd]

    50. Mfcd00886588

    51. Nsc759186

    52. Akos015895192

    53. Ab07649

    54. Ac-5599

    55. Calcium 3-acetamido-1-propanesulfonate

    56. Ccg-213526

    57. Ks-5292

    58. Nsc 759186

    59. Acamprosate Calcium [orange Book]

    60. Ncgc00256899-01

    61. Acamprosate Calcium [ep Monograph]

    62. Ba164134

    63. Acamprosate Calcium [usp Monograph]

    64. Db-056209

    65. Ft-0621712

    66. 3-acetamido-1-propanesulfonate Calcium

    67. 3-acetamido-1-propanesulphonate Calcium

    68. D02780

    69. T71327

    70. 3-acetamido-1-propanesulfonic Acid Calcium Salt

    71. A839056

    72. Calcium 3-(acetylamino)propane-1-sulphonate

    73. Q27122289

    74. 3-(acetylamino)-1-propanesulfonic Acid Hemicalcium Salt

    75. Z1696861853

    76. 5-methoxy-2-methyl-1-propyl-1h-indole-3-carboxylicacid

    77. 1-propanesulfonic Acid, 3-(acetylamino)-, Calcium Salt (2:1)

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 400.5 g/mol
    Molecular Formula C10H20CaN2O8S2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count6
    Exact Mass400.0286988 g/mol
    Monoisotopic Mass400.0286988 g/mol
    Topological Polar Surface Area189 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity202
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
    4 Drug and Medication Information
    4.1 Drug Information
    1 of 2  
    Drug NameAcamprosate calcium
    Drug LabelCampral (acamprosate calcium) is supplied in an enteric-coated tablet for oral administration. Acamprosate calcium is a synthetic compound with a chemical structure similar to that of the endogenous amino acid homotaurine, which is a structural analo...
    Active IngredientAcamprosate calcium
    Dosage FormTablet, delayed release
    RouteOral
    Strength333mg
    Market StatusPrescription
    CompanyMylan Pharms; Glenmark Generics; Barr Labs Div Teva

    2 of 2  
    Drug NameAcamprosate calcium
    Drug LabelCampral (acamprosate calcium) is supplied in an enteric-coated tablet for oral administration. Acamprosate calcium is a synthetic compound with a chemical structure similar to that of the endogenous amino acid homotaurine, which is a structural analo...
    Active IngredientAcamprosate calcium
    Dosage FormTablet, delayed release
    RouteOral
    Strength333mg
    Market StatusPrescription
    CompanyMylan Pharms; Glenmark Generics; Barr Labs Div Teva

    5 Pharmacology and Biochemistry
    5.1 MeSH Pharmacological Classification

    Alcohol Deterrents

    Substances interfering with the metabolism of ethyl alcohol, causing unpleasant side effects thought to discourage the drinking of alcoholic beverages. Alcohol deterrents are used in the treatment of alcoholism. (See all compounds classified as Alcohol Deterrents.)

    API Reference Price

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    18-Jan-2021
    21-Sep-2024
    KGS
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